Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGPAT2 | O15120 | 3/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.42 |
| ▸ | CALCA | P06881 | 1/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.41 |
| ▸ | ACP1 | P24666 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | DOT1L | Q8TEK3 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5743241 | 0.95 | AGPAT2 (0.53) | AGPAT2ROCK2LMNATP53MAPT | |
| SCHEMBL5742005 | 0.92 | AGPAT2 (0.59) | AGPAT2ROCK2TP53MAPTAURKA | |
| SCHEMBL5742912 | 0.92 | AGPAT2 (0.59) | AGPAT2ROCK2TP53MAPTAURKA | |
| SCHEMBL5740176 | 0.92 | AGPAT2 (0.56) | AGPAT2ROCK2LMNATP53MAPT | |
| SCHEMBL5741808 | 0.91 | MCHR1 (0.50) | AGPAT2ROCK2TP53MAPTAURKA | |
| SCHEMBL5741794 | 0.91 | MCHR1 (0.50) | AGPAT2ROCK2TP53MAPTAURKA | |
| SCHEMBL5741921 | 0.90 | AGPAT2 (0.51) | AGPAT2ROCK2LMNATP53MAPT | |
| SCHEMBL5744254 | 0.90 | AGPAT2 (0.46) | AGPAT2ROCK2AURKAPDPK1TGFBR1 | |
| SCHEMBL5742032 | 0.90 | AGPAT2 (0.46) | AGPAT2ROCK2AURKAPDPK1TGFBR1 | |
| SCHEMBL5740482 | 0.89 | ALOX15 (0.48) | AGPAT2ROCK2LMNATP53MAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1339706-B1 | N-TYPE CALCIUM CHANNEL ANTAGONISTS FOR THE TREATMENT OF PAIN | ASTRAZENECA AB (SE) | 2006-04-19 | — | — | EP | disclosed |